SCHEMBL11224970

SCHEMBL11224970

C=C(C)CNc1ccc(NS(C)(=O)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
KDM4E B2RXH2 3/20 0.52
HPGD P15428 2/20 0.52
ALDH1A1 P00352 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
HTT P42858 1/20 0.52
KEAP1 Q14145 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
PTGS2 P35354 2/20 0.45
RECQL P46063 1/20 0.45
CYP2C9 P11712 1/20 0.45
KIF11 P52732 2/20 0.44
ADRB2 P07550 2/20 0.43
ADRB1 P08588 2/20 0.43
ADRB3 P13945 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL4577309 0.80 KEAP1 (0.53) LMNAKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL5342654 0.80 KEAP1 (0.53) LMNAKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL9095121 0.80 EP300 (0.44) LMNAKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL27608606 0.77 LMNA (0.59) LMNAKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL12054668 0.76 KEAP1 (0.75) LMNAKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL5674547 0.75 CYP2C9 (0.61) LMNAKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL2760336 0.75 MAPT (0.54) KDM4EHPGDALDH1A1HTTCA12
SCHEMBL20897137 0.75 ALDH1A1 (0.46) LMNAKDM4EHPGDALDH1A1CA12
SCHEMBL8374389 0.73 HPGD (0.61) LMNAHPGDALDH1A1SMN1; SMN2KEAP1
SCHEMBL4577297 0.73 HPGD (0.63) LMNAKDM4EHPGDALDH1A1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0022813-A4 IMAGING COMPOSITION FEATURING AROMATIC DIALDEHYDE-RETAINING BINDERS. EASTMAN KODAK CO (US) 1982-04-29 EP disclosed
EP-0022813-A1 IMAGING COMPOSITION FEATURING AROMATIC DIALDEHYDE-RETAINING BINDERS. EASTMAN KODAK CO (US) 1981-01-28 EP disclosed
WO-1980001322-A1 IMAGING COMPOSITION FEATURING AROMATIC DIALDEHYDE-RETAINING BINDERS EASTMAN KODAK CO (US) 1980-06-26 WO disclosed